4-azanyl-5-chloranyl-2-pent-3-yn-2-yloxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-pent-3-yn-2-yloxy-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: 4-amino-N-(1-benzylpyrrolidin-3-yl)-5-chloro-2-(1-methylbut-2-ynoxy)benzamide CAS Name: 4-amino-5-chloro-2-pent-3-yn-2-yloxy-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: 4-amino-N-(1-benzylpyrrolidin-3-yl)-5-chloro-2-pent-3-yn-2-yloxybenzamide Traditional Name: 4-amino-N-(1-benzylpyrrolidin-3-yl)-5-chloro-2-(1-methylbut-2-ynoxy)benzamide Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)OC1=CC(=C(C=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)Cl)N

Isomeric SMILES

CC#CC(C)OC1=CC(=C(C=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)Cl)N

InChI

InChI=1S/C23H26ClN3O2/c1-3-7-16(2)29-22-13-21(25)20(24)12-19(22)23(28)26-18-10-11-27(15-18)14-17-8-5-4-6-9-17/h4-6,8-9,12-13,16,18H,10-11,14-15,25H2,1-2H3,(H,26,28)