2-[4-(3-methoxy-2-methoxycarbonyl-3-oxidanylidene-prop-1-enyl)phenoxy]ethyl-methyl-[2-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-3-yl]sulfanium

Systemtic Name: 2-[4-(3-methoxy-2-methoxycarbonyl-3-oxidanylidene-prop-1-enyl)phenoxy]ethyl-methyl-[2-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-1,8-naphthyridin-3-yl]sulfanium Openeye Name: (1-benzyl-2-hydroxy-4-oxo-1,8-naphthyridin-3-yl)-[2-[4-(3-methoxy-2-methoxycarbonyl-3-oxo-prop-1-enyl)phenoxy]ethyl]-methyl-sulfonium CAS Name: [2-hydroxy-4-oxo-1-(phenylmethyl)-1,8-naphthyridin-3-yl]-[2-[4-(3-methoxy-2-methoxycarbonyl-3-oxoprop-1-enyl)phenoxy]ethyl]-methylsulfonium IUPAC Name: (1-benzyl-2-hydroxy-4-oxo-1,8-naphthyridin-3-yl)-[2-[4-(3-methoxy-2-methoxycarbonyl-3-oxoprop-1-enyl)phenoxy]ethyl]-methylsulfanium Traditional Name: (1-benzyl-2-hydroxy-4-keto-1,8-naphthyridin-3-yl)-[2-[4-(2-carbomethoxy-3-keto-3-methoxy-prop-1-enyl)phenoxy]ethyl]-methyl-sulfonium Formula: C30H29N2O7S+ MolecularWeight: 561.62546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(C=C1)OCC[S+](C)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CC=C4)O)C(=O)OC

Isomeric SMILES

COC(=O)C(=CC1=CC=C(C=C1)OCC[S+](C)C2=C(N(C3=C(C2=O)C=CC=N3)CC4=CC=CC=C4)O)C(=O)OC

InChI

InChI=1S/C30H28N2O7S/c1-37-29(35)24(30(36)38-2)18-20-11-13-22(14-12-20)39-16-17-40(3)26-25(33)23-10-7-15-31-27(23)32(28(26)34)19-21-8-5-4-6-9-21/h4-15,18H,16-17,19H2,1-3H3/p+1