5-methyl-4-(4-phenylpiperidin-1-yl)carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile

Systemtic Name: 5-methyl-4-(4-phenylpiperidin-1-yl)carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 5-methyl-4-(4-phenylpiperidine-1-carbonyl)-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 5-methyl-4-[oxo-(4-phenyl-1-piperidinyl)methyl]-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 5-methyl-4-(4-phenylpiperidine-1-carbonyl)-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 5-methyl-4-(4-phenylpiperidine-1-carbonyl)-2-pyrrol-1-yl-3-furonitrile Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2/c1-16-20(19(15-23)22(27-16)25-11-5-6-12-25)21(26)24-13-9-18(10-14-24)17-7-3-2-4-8-17/h2-8,11-12,18H,9-10,13-14H2,1H3