1-[1-[4-(aminomethyl)-3-methyl-phenyl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-[4-(aminomethyl)-3-methyl-phenyl]carbonylpiperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[4-(aminomethyl)-3-methyl-benzoyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[[4-(aminomethyl)-3-methylphenyl]-oxomethyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[4-(aminomethyl)-3-methylbenzoyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[4-(aminomethyl)-3-methyl-benzoyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)CN

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)CN

InChI

InChI=1S/C22H25N3O3/c1-15-12-16(6-7-17(15)13-23)21(26)24-10-8-19(9-11-24)25-20-5-3-2-4-18(20)14-28-22(25)27/h2-7,12,19H,8-11,13-14,23H2,1H3