(6E)-2-nitro-6-[[[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-nitro-6-[[[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-nitro-6-[[[1-[2-(1-piperidyl)ethyl]benzimidazol-2-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-nitro-6-[[[1-[2-(1-piperidinyl)ethyl]-2-benzimidazolyl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-nitro-6-[[[1-(2-piperidin-1-ylethyl)benzimidazol-2-yl]amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-nitro-6-[[[1-(2-piperidinoethyl)benzimidazol-2-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN2C3=CC=CC=C3N=C2NC=C4C=CC=C(C4=O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CCN2C3=CC=CC=C3N=C2N/C=C/4\C=CC=C(C4=O)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O3/c27-20-16(7-6-10-19(20)26(28)29)15-22-21-23-17-8-2-3-9-18(17)25(21)14-13-24-11-4-1-5-12-24/h2-3,6-10,15H,1,4-5,11-14H2,(H,22,23)/b16-15+