1-[3-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propyl-amino]propyl]-1,4-diazepan-2-one

Systemtic Name: 1-[3-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propyl-amino]propyl]-1,4-diazepan-2-one Openeye Name: 1-[3-[(7-nitrotetralin-2-yl)-propyl-amino]propyl]-1,4-diazepan-2-one CAS Name: 1-[3-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]propyl]-1,4-diazepan-2-one IUPAC Name: 1-[3-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]propyl]-1,4-diazepan-2-one Traditional Name: 1-[3-[(7-nitrotetralin-2-yl)-propyl-amino]propyl]-1,4-diazepan-2-one Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCN1CCCNCC1=O)C2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCCN1CCCNCC1=O)C2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H32N4O3/c1-2-10-23(12-4-13-24-11-3-9-22-16-21(24)26)19-7-5-17-6-8-20(25(27)28)15-18(17)14-19/h6,8,15,19,22H,2-5,7,9-14,16H2,1H3