4-azanyl-N-[[1-(2-benzamidoethyl)pyrrolidin-3-yl]methyl]-5-chloranyl-2-methoxy-benzamide

Systemtic Name: 4-azanyl-N-[[1-(2-benzamidoethyl)pyrrolidin-3-yl]methyl]-5-chloranyl-2-methoxy-benzamide Openeye Name: 4-amino-N-[[1-(2-benzamidoethyl)pyrrolidin-3-yl]methyl]-5-chloro-2-methoxy-benzamide CAS Name: 4-amino-N-[[1-(2-benzamidoethyl)-3-pyrrolidinyl]methyl]-5-chloro-2-methoxybenzamide IUPAC Name: 4-amino-N-[[1-(2-benzamidoethyl)pyrrolidin-3-yl]methyl]-5-chloro-2-methoxybenzamide Traditional Name: 4-amino-N-[[1-(2-benzamidoethyl)pyrrolidin-3-yl]methyl]-5-chloro-2-methoxy-benzamide Formula: C22H27ClN4O3 MolecularWeight: 430.92778

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2CCN(C2)CCNC(=O)C3=CC=CC=C3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2CCN(C2)CCNC(=O)C3=CC=CC=C3)Cl)N

InChI

InChI=1S/C22H27ClN4O3/c1-30-20-12-19(24)18(23)11-17(20)22(29)26-13-15-7-9-27(14-15)10-8-25-21(28)16-5-3-2-4-6-16/h2-6,11-12,15H,7-10,13-14,24H2,1H3,(H,25,28)(H,26,29)