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

Systemtic Name: 5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]-2,2-dipropyl-acenaphthylen-1-one Openeye Name: 5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]-2,2-dipropyl-acenaphthylen-1-one CAS Name: 5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]-2,2-dipropyl-1-acenaphthylenone IUPAC Name: 5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]-2,2-dipropylacenaphthylen-1-one Traditional Name: 5-[4-(cyclobutylmethyl)-1,4-diazepan-1-yl]-2,2-dipropyl-acenaphthen-1-one Formula: C28H38N2O MolecularWeight: 418.61412

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CC5CCC5)C=CC=C3C1=O)CCC

Isomeric SMILES

CCCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CC5CCC5)C=CC=C3C1=O)CCC

InChI

InChI=1S/C28H38N2O/c1-3-14-28(15-4-2)24-12-13-25(22-10-6-11-23(26(22)24)27(28)31)30-17-7-16-29(18-19-30)20-21-8-5-9-21/h6,10-13,21H,3-5,7-9,14-20H2,1-2H3