4-azanyl-5-chloranyl-2-methoxy-N-[1-[(1-prop-2-enoylpiperidin-4-yl)methyl]piperidin-4-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[1-[(1-prop-2-enoylpiperidin-4-yl)methyl]piperidin-4-yl]benzamide Openeye Name: 4-amino-5-chloro-2-methoxy-N-[1-[(1-prop-2-enoyl-4-piperidyl)methyl]-4-piperidyl]benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-(1-oxoprop-2-enyl)-4-piperidinyl]methyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[1-[(1-prop-2-enoylpiperidin-4-yl)methyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[(1-acryloyl-4-piperidyl)methyl]-4-piperidyl]-4-amino-5-chloro-2-methoxy-benzamide Formula: C22H31ClN4O3 MolecularWeight: 434.95954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)C=C)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)C=C)Cl)N

InChI

InChI=1S/C22H31ClN4O3/c1-3-21(28)27-10-4-15(5-11-27)14-26-8-6-16(7-9-26)25-22(29)17-12-18(23)19(24)13-20(17)30-2/h3,12-13,15-16H,1,4-11,14,24H2,2H3,(H,25,29)