3-(naphthalen-2-ylmethylamino)-2-[[5-(phenylcarbamoyl)furan-2-yl]methyl]butanoate

Systemtic Name: 3-(naphthalen-2-ylmethylamino)-2-[[5-(phenylcarbamoyl)furan-2-yl]methyl]butanoate Openeye Name: 3-(2-naphthylmethylamino)-2-[[5-(phenylcarbamoyl)-2-furyl]methyl]butanoate CAS Name: 2-[[5-[anilino(oxo)methyl]-2-furanyl]methyl]-3-(2-naphthalenylmethylamino)butanoate IUPAC Name: 3-(naphthalen-2-ylmethylamino)-2-[[5-(phenylcarbamoyl)furan-2-yl]methyl]butanoate Traditional Name: 3-(2-naphthylmethylamino)-2-[[5-(phenylcarbamoyl)-2-furyl]methyl]butyrate Formula: C27H25N2O4- MolecularWeight: 441.4984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=C(O1)C(=O)NC2=CC=CC=C2)C(=O)[O-])NCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(CC1=CC=C(O1)C(=O)NC2=CC=CC=C2)C(=O)[O-])NCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H26N2O4/c1-18(28-17-19-11-12-20-7-5-6-8-21(20)15-19)24(27(31)32)16-23-13-14-25(33-23)26(30)29-22-9-3-2-4-10-22/h2-15,18,24,28H,16-17H2,1H3,(H,29,30)(H,31,32)/p-1