1-[1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]piperidin-4-yl]-N-propan-2-yl-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]piperidin-4-yl]-N-propan-2-yl-1,2,3-triazole-4-carboxamide Openeye Name: 1-[1-[(3-ethoxy-2-hydroxy-phenyl)methyl]-4-piperidyl]-N-isopropyl-triazole-4-carboxamide CAS Name: 1-[1-[(3-ethoxy-2-hydroxyphenyl)methyl]-4-piperidinyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: 1-[1-[(3-ethoxy-2-hydroxyphenyl)methyl]piperidin-4-yl]-N-propan-2-yltriazole-4-carboxamide Traditional Name: 1-[1-(3-ethoxy-2-hydroxy-benzyl)-4-piperidyl]-N-isopropyl-triazole-4-carboxamide Formula: C20H29N5O3 MolecularWeight: 387.47596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)CN2CCC(CC2)N3C=C(N=N3)C(=O)NC(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1O)CN2CCC(CC2)N3C=C(N=N3)C(=O)NC(C)C

InChI

InChI=1S/C20H29N5O3/c1-4-28-18-7-5-6-15(19(18)26)12-24-10-8-16(9-11-24)25-13-17(22-23-25)20(27)21-14(2)3/h5-7,13-14,16,26H,4,8-12H2,1-3H3,(H,21,27)