N-[2-[(2-ethyl-3-methyl-phenyl)amino]ethyl]-7-phenylmethoxy-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide

Systemtic Name: N-[2-[(2-ethyl-3-methyl-phenyl)amino]ethyl]-7-phenylmethoxy-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Openeye Name: 7-benzyloxy-N-[2-(2-ethyl-3-methyl-anilino)ethyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide CAS Name: N-[2-(2-ethyl-3-methylanilino)ethyl]-7-phenylmethoxy-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide IUPAC Name: N-[2-(2-ethyl-3-methylanilino)ethyl]-7-phenylmethoxy-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Traditional Name: 7-benzoxy-N-[2-(2-ethyl-3-methyl-anilino)ethyl]-2,3,4,5-tetrahydro-1-benzazepine-1-carboxamide Formula: C29H35N3O2 MolecularWeight: 457.6071

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NCCNC(=O)N2CCCCC3=C2C=CC(=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CCC1=C(C=CC=C1NCCNC(=O)N2CCCCC3=C2C=CC(=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C29H35N3O2/c1-3-26-22(2)10-9-14-27(26)30-17-18-31-29(33)32-19-8-7-13-24-20-25(15-16-28(24)32)34-21-23-11-5-4-6-12-23/h4-6,9-12,14-16,20,30H,3,7-8,13,17-19,21H2,1-2H3,(H,31,33)