4-tert-butyl-N-[(Z)-1-(3-nitrophenyl)-3-oxidanylidene-3-[(phenylmethyl)amino]prop-1-en-2-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[(Z)-1-(3-nitrophenyl)-3-oxidanylidene-3-[(phenylmethyl)amino]prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-1-(benzylcarbamoyl)-2-(3-nitrophenyl)vinyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[(Z)-1-(3-nitrophenyl)-3-oxo-3-[(phenylmethyl)amino]prop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-3-(benzylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide Traditional Name: N-[(Z)-1-(benzylcarbamoyl)-2-(3-nitrophenyl)vinyl]-4-tert-butyl-benzamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H27N3O4/c1-27(2,3)22-14-12-21(13-15-22)25(31)29-24(17-20-10-7-11-23(16-20)30(33)34)26(32)28-18-19-8-5-4-6-9-19/h4-17H,18H2,1-3H3,(H,28,32)(H,29,31)/b24-17-