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5-(4-azanylbutyl)-3-(2-methylpropyl)-1-nonyl-3H-1,4-benzodiazepin-2-one

5-(4-azanylbutyl)-3-(2-methylpropyl)-1-nonyl-3H-1,4-benzodiazepin-2-one

Systemtic Name:5-(4-azanylbutyl)-3-(2-methylpropyl)-1-nonyl-3H-1,4-benzodiazepin-2-one
Openeye Name:5-(4-aminobutyl)-3-isobutyl-1-nonyl-3H-1,4-benzodiazepin-2-one
CAS Name:5-(4-aminobutyl)-3-(2-methylpropyl)-1-nonyl-3H-1,4-benzodiazepin-2-one
IUPAC Name:5-(4-aminobutyl)-3-(2-methylpropyl)-1-nonyl-3H-1,4-benzodiazepin-2-one
Traditional Name:5-(4-aminobutyl)-3-isobutyl-1-nonyl-3H-1,4-benzodiazepin-2-one
Formula: C26H43N3O
MolecularWeight: 413.63912
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C2=CC=CC=C2C(=NC(C1=O)CC(C)C)CCCCN


Isomeric SMILES

CCCCCCCCCN1C2=CC=CC=C2C(=NC(C1=O)CC(C)C)CCCCN


InChI

InChI=1S/C26H43N3O/c1-4-5-6-7-8-9-14-19-29-25-17-11-10-15-22(25)23(16-12-13-18-27)28-24(26(29)30)20-21(2)3/h10-11,15,17,21,24H,4-9,12-14,16,18-20,27H2,1-3H3


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