(4-heptoxyphenyl)-[4-(4-heptoxyphenyl)carbonyl-1,4-diazepan-1-yl]methanone

Systemtic Name: (4-heptoxyphenyl)-[4-(4-heptoxyphenyl)carbonyl-1,4-diazepan-1-yl]methanone Openeye Name: [4-(4-heptoxybenzoyl)-1,4-diazepan-1-yl]-(4-heptoxyphenyl)methanone CAS Name: (4-heptoxyphenyl)-[4-[(4-heptoxyphenyl)-oxomethyl]-1,4-diazepan-1-yl]methanone IUPAC Name: [4-(4-heptoxybenzoyl)-1,4-diazepan-1-yl]-(4-heptoxyphenyl)methanone Traditional Name: [4-(4-heptoxybenzoyl)-1,4-diazepan-1-yl]-(4-heptoxyphenyl)methanone Formula: C33H48N2O4 MolecularWeight: 536.74522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)OCCCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC=C(C=C3)OCCCCCCC

InChI

InChI=1S/C33H48N2O4/c1-3-5-7-9-11-26-38-30-18-14-28(15-19-30)32(36)34-22-13-23-35(25-24-34)33(37)29-16-20-31(21-17-29)39-27-12-10-8-6-4-2/h14-21H,3-13,22-27H2,1-2H3