2,2-dibutyl-5-(4-propan-2-yl-1,4-diazepan-1-yl)acenaphthylen-1-one

Systemtic Name: 2,2-dibutyl-5-(4-propan-2-yl-1,4-diazepan-1-yl)acenaphthylen-1-one Openeye Name: 2,2-dibutyl-5-(4-isopropyl-1,4-diazepan-1-yl)acenaphthylen-1-one CAS Name: 2,2-dibutyl-5-(4-propan-2-yl-1,4-diazepan-1-yl)-1-acenaphthylenone IUPAC Name: 2,2-dibutyl-5-(4-propan-2-yl-1,4-diazepan-1-yl)acenaphthylen-1-one Traditional Name: 2,2-dibutyl-5-(4-isopropyl-1,4-diazepan-1-yl)acenaphthen-1-one Formula: C28H40N2O MolecularWeight: 420.63

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N2O/c1-5-7-15-28(16-8-6-2)24-13-14-25(22-11-9-12-23(26(22)24)27(28)31)30-18-10-17-29(19-20-30)21(3)4/h9,11-14,21H,5-8,10,15-20H2,1-4H3