N-(4-phenylbutan-2-yl)-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(4-phenylbutan-2-yl)-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-benzyl-N-(1-methyl-3-phenyl-propyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(4-phenylbutan-2-yl)-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-benzyl-N-(4-phenylbutan-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-benzyl-N-(1-methyl-3-phenyl-propyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(CCC1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C27H29NO3/c1-21(13-14-22-9-4-2-5-10-22)28(20-23-11-6-3-7-12-23)27(29)24-15-16-25-26(19-24)31-18-8-17-30-25/h2-7,9-12,15-16,19,21H,8,13-14,17-18,20H2,1H3