[4-(3-azanylpropyl)-1,4-diazepan-1-yl]-(2,3-dimethylphenyl)methanone

Systemtic Name: [4-(3-azanylpropyl)-1,4-diazepan-1-yl]-(2,3-dimethylphenyl)methanone Openeye Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(2,3-dimethylphenyl)methanone CAS Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(2,3-dimethylphenyl)methanone IUPAC Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(2,3-dimethylphenyl)methanone Traditional Name: [4-(3-aminopropyl)-1,4-diazepan-1-yl]-(2,3-dimethylphenyl)methanone Formula: C17H27N3O MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C(=O)N2CCCN(CC2)CCCN

Isomeric SMILES

CC1=CC=CC(=C1C)C(=O)N2CCCN(CC2)CCCN

InChI

InChI=1S/C17H27N3O/c1-14-6-3-7-16(15(14)2)17(21)20-11-5-10-19(12-13-20)9-4-8-18/h3,6-7H,4-5,8-13,18H2,1-2H3