4-[3-(aminomethyl)phenyl]-1-[5-[(Z)-2-phenylethenyl]pyridin-3-yl]carbonyl-piperidine-4-carbonitrile

Systemtic Name: 4-[3-(aminomethyl)phenyl]-1-[5-[(Z)-2-phenylethenyl]pyridin-3-yl]carbonyl-piperidine-4-carbonitrile Openeye Name: 4-[3-(aminomethyl)phenyl]-1-[5-[(Z)-styryl]pyridine-3-carbonyl]piperidine-4-carbonitrile CAS Name: 4-[3-(aminomethyl)phenyl]-1-[oxo-[5-[(Z)-2-phenylethenyl]-3-pyridinyl]methyl]-4-piperidinecarbonitrile IUPAC Name: 4-[3-(aminomethyl)phenyl]-1-[5-[(Z)-2-phenylethenyl]pyridine-3-carbonyl]piperidine-4-carbonitrile Traditional Name: 4-[3-(aminomethyl)phenyl]-1-[5-[(Z)-styryl]nicotinoyl]isonipecotonitrile Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C2=CC(=CC=C2)CN)C(=O)C3=CN=CC(=C3)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1(C#N)C2=CC(=CC=C2)CN)C(=O)C3=CN=CC(=C3)/C=C\C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O/c28-17-22-7-4-8-25(16-22)27(20-29)11-13-31(14-12-27)26(32)24-15-23(18-30-19-24)10-9-21-5-2-1-3-6-21/h1-10,15-16,18-19H,11-14,17,28H2/b10-9-