7-nitro-5-[(1-phenylpent-4-en-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione

Systemtic Name: 7-nitro-5-[(1-phenylpent-4-en-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione Openeye Name: 5-[(1-benzylbut-3-enylamino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-dione CAS Name: 7-nitro-5-[(1-phenylpent-4-en-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione IUPAC Name: 7-nitro-5-[(1-phenylpent-4-en-2-ylamino)methyl]-1,4-dihydroquinoxaline-2,3-dione Traditional Name: 5-[(1-benzylbut-3-enylamino)methyl]-7-nitro-1,4-dihydroquinoxaline-2,3-quinone Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC1=CC=CC=C1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]

Isomeric SMILES

C=CCC(CC1=CC=CC=C1)NCC2=CC(=CC3=C2NC(=O)C(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-2-6-15(9-13-7-4-3-5-8-13)21-12-14-10-16(24(27)28)11-17-18(14)23-20(26)19(25)22-17/h2-5,7-8,10-11,15,21H,1,6,9,12H2,(H,22,25)(H,23,26)