1-[(4-methoxyphenyl)methyl]-7-[4-(1-propoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-7-[4-(1-propoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)methyl]-7-[4-(1-propoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)methyl]-7-[4-(1-propoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)methyl]-7-[4-(1-propoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid Traditional Name: 1-p-anisyl-7-[4-(1-propoxyethoxy)phenyl]-2,3-dihydro-1-benzazepine-4-carboxylic acid Formula: C30H33NO5 MolecularWeight: 487.58672

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C)OC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)O)CC4=CC=C(C=C4)OC

Isomeric SMILES

CCCOC(C)OC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)O)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C30H33NO5/c1-4-17-35-21(2)36-28-12-7-23(8-13-28)24-9-14-29-26(18-24)19-25(30(32)33)15-16-31(29)20-22-5-10-27(34-3)11-6-22/h5-14,18-19,21H,4,15-17,20H2,1-3H3,(H,32,33)