5-chloranyl-2-methoxy-N-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-4-(propanoylamino)benzamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-4-(propanoylamino)benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-(propanoylamino)benzamide CAS Name: 5-chloro-2-methoxy-4-(1-oxopropylamino)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-(propanoylamino)benzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-5-chloro-2-methoxy-4-propionamido-benzamide Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2CCN(C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)N[C@H]2CCN(C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H26ClN3O3/c1-3-21(27)25-19-12-20(29-2)17(11-18(19)23)22(28)24-16-9-10-26(14-16)13-15-7-5-4-6-8-15/h4-8,11-12,16H,3,9-10,13-14H2,1-2H3,(H,24,28)(H,25,27)/t16-/m0/s1