1-[[4-(3-azanylpropoxy)phenyl]methyl]-4-propyl-3H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 1-[[4-(3-azanylpropoxy)phenyl]methyl]-4-propyl-3H-1,4-benzodiazepine-2,5-dione Openeye Name: 1-[[4-(3-aminopropoxy)phenyl]methyl]-4-propyl-3H-1,4-benzodiazepine-2,5-dione CAS Name: 1-[[4-(3-aminopropoxy)phenyl]methyl]-4-propyl-3H-1,4-benzodiazepine-2,5-dione IUPAC Name: 1-[[4-(3-aminopropoxy)phenyl]methyl]-4-propyl-3H-1,4-benzodiazepine-2,5-dione Traditional Name: 1-[4-(3-aminopropoxy)benzyl]-4-propyl-3H-1,4-benzodiazepine-2,5-quinone Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC(=O)N(C2=CC=CC=C2C1=O)CC3=CC=C(C=C3)OCCCN

Isomeric SMILES

CCCN1CC(=O)N(C2=CC=CC=C2C1=O)CC3=CC=C(C=C3)OCCCN

InChI

InChI=1S/C22H27N3O3/c1-2-13-24-16-21(26)25(20-7-4-3-6-19(20)22(24)27)15-17-8-10-18(11-9-17)28-14-5-12-23/h3-4,6-11H,2,5,12-16,23H2,1H3