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

Systemtic Name: (2R)-6-[(1S)-1-azanylpropyl]-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one Openeye Name: (2R)-6-[(1S)-1-aminopropyl]-4-isopentyl-2-methyl-1,4-benzoxazin-3-one CAS Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-[(1S)-1-aminopropyl]-2-methyl-4-(3-methylbutyl)-1,4-benzoxazin-3-one Traditional Name: (2R)-6-[(1S)-1-aminopropyl]-4-isoamyl-2-methyl-1,4-benzoxazin-3-one Formula: C17H26N2O2 MolecularWeight: 290.40054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OC(C(=O)N2CCC(C)C)C)N

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)O[C@@H](C(=O)N2CCC(C)C)C)N

InChI

InChI=1S/C17H26N2O2/c1-5-14(18)13-6-7-16-15(10-13)19(9-8-11(2)3)17(20)12(4)21-16/h6-7,10-12,14H,5,8-9,18H2,1-4H3/t12-,14+/m1/s1