4-azanyl-5-chloranyl-2-methoxy-N-[1-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidin-4-yl]methyl]piperidin-4-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[1-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidin-4-yl]methyl]piperidin-4-yl]benzamide Openeye Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-3-(4-piperidyl)prop-2-enoyl]-4-piperidyl]methyl]-4-piperidyl]benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-1-oxo-3-(4-piperidinyl)prop-2-enyl]-4-piperidinyl]methyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidin-4-yl]methyl]piperidin-4-yl]benzamide Traditional Name: 4-amino-5-chloro-2-methoxy-N-[1-[[1-[(E)-3-(4-piperidyl)acryloyl]-4-piperidyl]methyl]-4-piperidyl]benzamide Formula: C27H40ClN5O3 MolecularWeight: 518.0912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)C=CC4CCNCC4)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)/C=C/C4CCNCC4)Cl)N

InChI

InChI=1S/C27H40ClN5O3/c1-36-25-17-24(29)23(28)16-22(25)27(35)31-21-8-12-32(13-9-21)18-20-6-14-33(15-7-20)26(34)3-2-19-4-10-30-11-5-19/h2-3,16-17,19-21,30H,4-15,18,29H2,1H3,(H,31,35)/b3-2+