(2R)-2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: (2R)-2-[(5-chloro-2-thienyl)methyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: (2R)-2-[(5-chloro-2-thiophenyl)methyl-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: (2R)-2-[(5-chlorothiophen-2-yl)methyl-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: (2R)-2-[(5-chloro-2-thienyl)methyl-methyl-amino]-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C16H18ClN3O4S MolecularWeight: 383.84982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N(C)CC2=CC=C(S2)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N(C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C16H18ClN3O4S/c1-10(19(2)9-12-5-7-15(17)25-12)16(21)18-13-8-11(20(22)23)4-6-14(13)24-3/h4-8,10H,9H2,1-3H3,(H,18,21)/t10-/m1/s1