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5-(4-butyl-1,4-diazepan-1-yl)-2,2-dipentyl-acenaphthylen-1-one

5-(4-butyl-1,4-diazepan-1-yl)-2,2-dipentyl-acenaphthylen-1-one

Systemtic Name:5-(4-butyl-1,4-diazepan-1-yl)-2,2-dipentyl-acenaphthylen-1-one
Openeye Name:5-(4-butyl-1,4-diazepan-1-yl)-2,2-dipentyl-acenaphthylen-1-one
CAS Name:5-(4-butyl-1,4-diazepan-1-yl)-2,2-dipentyl-1-acenaphthylenone
IUPAC Name:5-(4-butyl-1,4-diazepan-1-yl)-2,2-dipentylacenaphthylen-1-one
Traditional Name:2,2-diamyl-5-(4-butyl-1,4-diazepan-1-yl)acenaphthen-1-one
Formula: C31H46N2O
MolecularWeight: 462.70974
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CCCC)C=CC=C3C1=O)CCCCC


Isomeric SMILES

CCCCCC1(C2=C3C(=C(C=C2)N4CCCN(CC4)CCCC)C=CC=C3C1=O)CCCCC


InChI

InChI=1S/C31H46N2O/c1-4-7-10-18-31(19-11-8-5-2)27-16-17-28(25-14-12-15-26(29(25)27)30(31)34)33-22-13-21-32(23-24-33)20-9-6-3/h12,14-17H,4-11,13,18-24H2,1-3H3


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