1-[(E)-2-cyano-3-[1-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]indol-3-yl]prop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-2-cyano-3-[1-[2-(5-methyl-2-propan-2-yl-phenoxy)ethyl]indol-3-yl]prop-2-enoyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-2-cyano-3-[1-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]indol-3-yl]prop-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-2-cyano-3-[1-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]-3-indolyl]-1-oxoprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-2-cyano-3-[1-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]indol-3-yl]prop-2-enoyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-2-cyano-3-[1-[2-(2-isopropyl-5-methyl-phenoxy)ethyl]indol-3-yl]acryloyl]isonipecotamide Formula: C30H34N4O3 MolecularWeight: 498.61596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCN2C=C(C3=CC=CC=C32)/C=C(\C#N)/C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C30H34N4O3/c1-20(2)25-9-8-21(3)16-28(25)37-15-14-34-19-24(26-6-4-5-7-27(26)34)17-23(18-31)30(36)33-12-10-22(11-13-33)29(32)35/h4-9,16-17,19-20,22H,10-15H2,1-3H3,(H2,32,35)/b23-17+