(2R)-6-[(1S)-1-azanylpropyl]-2-methyl-4-(3-phenylpropyl)-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-[(1S)-1-azanylpropyl]-2-methyl-4-(3-phenylpropyl)-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(3-phenylpropyl)-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(3-phenylpropyl)-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(3-phenylpropyl)-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(3-phenylpropyl)-1,4-benzoxazin-3-one Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC(C(=O)N2CCCC3=CC=CC=C3)C)N

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)O[C@@H](C(=O)N2CCCC3=CC=CC=C3)C)N

InChI

InChI=1S/C21H26N2O2/c1-3-18(22)17-11-12-20-19(14-17)23(21(24)15(2)25-20)13-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-12,14-15,18H,3,7,10,13,22H2,1-2H3/t15-,18+/m1/s1