1-(3-methoxy-4-spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclohexene]-1-ylcarbonyl-phenyl)pyrrole-3-carbaldehyde

Systemtic Name: 1-(3-methoxy-4-spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclohexene]-1-ylcarbonyl-phenyl)pyrrole-3-carbaldehyde Openeye Name: 1-[3-methoxy-4-(spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclohexene]-1-carbonyl)phenyl]pyrrole-3-carbaldehyde CAS Name: 1-[3-methoxy-4-[oxo(1-spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclohexene]yl)methyl]phenyl]-3-pyrrolecarboxaldehyde IUPAC Name: 1-[3-methoxy-4-(spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclohexene]-1-carbonyl)phenyl]pyrrole-3-carbaldehyde Traditional Name: 1-[3-methoxy-4-(spiro[3,5-dihydro-2H-1-benzazepine-4,3'-cyclohexene]-1-carbonyl)phenyl]pyrrole-3-carbaldehyde Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2C=CC(=C2)C=O)C(=O)N3CCC4(CCCC=C4)CC5=CC=CC=C53

Isomeric SMILES

COC1=C(C=CC(=C1)N2C=CC(=C2)C=O)C(=O)N3CCC4(CCCC=C4)CC5=CC=CC=C53

InChI

InChI=1S/C28H28N2O3/c1-33-26-17-23(29-15-11-21(19-29)20-31)9-10-24(26)27(32)30-16-14-28(12-5-2-6-13-28)18-22-7-3-4-8-25(22)30/h3-5,7-12,15,17,19-20H,2,6,13-14,16,18H2,1H3