4-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propyl-amino]butyl]-1,4-oxazepan-5-one

Systemtic Name: 4-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propyl-amino]butyl]-1,4-oxazepan-5-one Openeye Name: 4-[4-[(7-nitrotetralin-2-yl)-propyl-amino]butyl]-1,4-oxazepan-5-one CAS Name: 4-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]butyl]-1,4-oxazepan-5-one IUPAC Name: 4-[4-[(7-nitro-1,2,3,4-tetrahydronaphthalen-2-yl)-propylamino]butyl]-1,4-oxazepan-5-one Traditional Name: 4-[4-[(7-nitrotetralin-2-yl)-propyl-amino]butyl]-1,4-oxazepan-5-one Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCN1CCOCCC1=O)C2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCCCN1CCOCCC1=O)C2CCC3=C(C2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H33N3O4/c1-2-10-23(11-3-4-12-24-13-15-29-14-9-22(24)26)20-7-5-18-6-8-21(25(27)28)17-19(18)16-20/h6,8,17,20H,2-5,7,9-16H2,1H3