6-[(1S)-1-azanylpropyl]-4-(naphthalen-1-ylmethyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-[(1S)-1-azanylpropyl]-4-(naphthalen-1-ylmethyl)-1,4-benzoxazin-3-one Openeye Name: 6-[(1S)-1-aminopropyl]-4-(1-naphthylmethyl)-1,4-benzoxazin-3-one CAS Name: 6-[(1S)-1-aminopropyl]-4-(1-naphthalenylmethyl)-1,4-benzoxazin-3-one IUPAC Name: 6-[(1S)-1-aminopropyl]-4-(naphthalen-1-ylmethyl)-1,4-benzoxazin-3-one Traditional Name: 6-[(1S)-1-aminopropyl]-4-(1-naphthylmethyl)-1,4-benzoxazin-3-one Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC4=CC=CC=C43)N

Isomeric SMILES

CC[C@@H](C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC4=CC=CC=C43)N

InChI

InChI=1S/C22H22N2O2/c1-2-19(23)16-10-11-21-20(12-16)24(22(25)14-26-21)13-17-8-5-7-15-6-3-4-9-18(15)17/h3-12,19H,2,13-14,23H2,1H3/t19-/m0/s1