2-[(4-methoxyphenyl)-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]amino]ethanoic acid

Systemtic Name: 2-[(4-methoxyphenyl)-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxidanylidene-ethyl]amino]ethanoic acid Openeye Name: 2-(4-methoxy-N-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxo-ethyl]anilino)acetic acid CAS Name: 2-(4-methoxy-N-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]anilino)acetic acid IUPAC Name: 2-(4-methoxy-N-[2-(4-methyl-1,4-diazepan-1-yl)-2-oxoethyl]anilino)acetic acid Traditional Name: 2-(N-[2-keto-2-(4-methyl-1,4-diazepan-1-yl)ethyl]-4-methoxy-anilino)acetic acid Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)CN(CC(=O)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CN1CCCN(CC1)C(=O)CN(CC(=O)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25N3O4/c1-18-8-3-9-19(11-10-18)16(21)12-20(13-17(22)23)14-4-6-15(24-2)7-5-14/h4-7H,3,8-13H2,1-2H3,(H,22,23)