N-naphthalen-2-yl-3-nitro-4-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]benzamide

Systemtic Name: N-naphthalen-2-yl-3-nitro-4-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]benzamide Openeye Name: 4-[4-[2-(allylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(2-naphthyl)-3-nitro-benzamide CAS Name: N-(2-naphthalenyl)-3-nitro-4-[4-[2-oxo-2-(prop-2-enylamino)ethyl]-1-piperazinyl]benzamide IUPAC Name: N-naphthalen-2-yl-3-nitro-4-[4-[2-oxo-2-(prop-2-enylamino)ethyl]piperazin-1-yl]benzamide Traditional Name: 4-[4-[2-(allylamino)-2-keto-ethyl]piperazino]-N-(2-naphthyl)-3-nitro-benzamide Formula: C26H27N5O4 MolecularWeight: 473.52368

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

C=CCNC(=O)CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H27N5O4/c1-2-11-27-25(32)18-29-12-14-30(15-13-29)23-10-8-21(17-24(23)31(34)35)26(33)28-22-9-7-19-5-3-4-6-20(19)16-22/h2-10,16-17H,1,11-15,18H2,(H,27,32)(H,28,33)