2-chloranyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[(4S)-chroman-4-yl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[(4S)-chroman-4-yl]-5-pyrrolidinosulfonyl-benzamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N[C@H]3CCOC4=CC=CC=C34

InChI

InChI=1S/C20H21ClN2O4S/c21-17-8-7-14(28(25,26)23-10-3-4-11-23)13-16(17)20(24)22-18-9-12-27-19-6-2-1-5-15(18)19/h1-2,5-8,13,18H,3-4,9-12H2,(H,22,24)/t18-/m0/s1