2,2-dibutyl-5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]acenaphthylen-1-one

Systemtic Name: 2,2-dibutyl-5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]acenaphthylen-1-one Openeye Name: 2,2-dibutyl-5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]acenaphthylen-1-one CAS Name: 2,2-dibutyl-5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]-1-acenaphthylenone IUPAC Name: 2,2-dibutyl-5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]acenaphthylen-1-one Traditional Name: 2,2-dibutyl-5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]acenaphthen-1-one Formula: C30H42N2O MolecularWeight: 446.66728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CC5CCC5)C=CC=C3C1=O)CCCC

Isomeric SMILES

CCCCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CC5CCC5)C=CC=C3C1=O)CCCC

InChI

InChI=1S/C30H42N2O/c1-3-5-16-30(17-6-4-2)26-14-15-27(24-12-8-13-25(28(24)26)29(30)33)32-19-9-18-31(20-21-32)22-23-10-7-11-23/h8,12-15,23H,3-7,9-11,16-22H2,1-2H3