N-[4-[[4-(4-cyclohex-2-en-1-yloxyphenyl)carbonyl-1,4-diazepan-1-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(4-cyclohex-2-en-1-yloxyphenyl)carbonyl-1,4-diazepan-1-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(4-cyclohex-2-en-1-yloxybenzoyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-[[4-(1-cyclohex-2-enyloxy)phenyl]-oxomethyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(4-cyclohex-2-en-1-yloxybenzoyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Traditional Name: N-[4-[[4-(4-cyclohex-2-en-1-yloxybenzoyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)OC4CCCC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC=C(C=C3)OC4CCCC=C4

InChI

InChI=1S/C27H33N3O3/c1-21(31)28-24-12-8-22(9-13-24)20-29-16-5-17-30(19-18-29)27(32)23-10-14-26(15-11-23)33-25-6-3-2-4-7-25/h3,6,8-15,25H,2,4-5,7,16-20H2,1H3,(H,28,31)