(2S)-2-(7-azanyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-chloranyl-2-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-(7-azanyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-chloranyl-2-methyl-phenyl)propanamide Openeye Name: (2S)-2-(7-amino-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-chloro-2-methyl-phenyl)propanamide CAS Name: (2S)-2-(7-amino-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-chloro-2-methylphenyl)propanamide IUPAC Name: (2S)-2-(7-amino-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-chloro-2-methylphenyl)propanamide Traditional Name: (2S)-2-(7-amino-2,3-dihydro-1,4-benzoxazin-4-yl)-N-(3-chloro-2-methyl-phenyl)propionamide Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)N2CCOC3=C2C=CC(=C3)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)[C@H](C)N2CCOC3=C2C=CC(=C3)N

InChI

InChI=1S/C18H20ClN3O2/c1-11-14(19)4-3-5-15(11)21-18(23)12(2)22-8-9-24-17-10-13(20)6-7-16(17)22/h3-7,10,12H,8-9,20H2,1-2H3,(H,21,23)/t12-/m0/s1