6-(2-azanylpropyl)-5-(4-methoxyphenyl)-1,2,3,4-tetrahydroazepin-7-one

Systemtic Name: 6-(2-azanylpropyl)-5-(4-methoxyphenyl)-1,2,3,4-tetrahydroazepin-7-one Openeye Name: 6-(2-aminopropyl)-5-(4-methoxyphenyl)-1,2,3,4-tetrahydroazepin-7-one CAS Name: 6-(2-aminopropyl)-5-(4-methoxyphenyl)-1,2,3,4-tetrahydroazepin-7-one IUPAC Name: 6-(2-aminopropyl)-5-(4-methoxyphenyl)-1,2,3,4-tetrahydroazepin-7-one Traditional Name: 6-(2-aminopropyl)-5-(4-methoxyphenyl)-1,2,3,4-tetrahydroazepin-7-one Formula: C16H22N2O2 MolecularWeight: 274.35808

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(CCCNC1=O)C2=CC=C(C=C2)OC)N

Isomeric SMILES

CC(CC1=C(CCCNC1=O)C2=CC=C(C=C2)OC)N

InChI

InChI=1S/C16H22N2O2/c1-11(17)10-15-14(4-3-9-18-16(15)19)12-5-7-13(20-2)8-6-12/h5-8,11H,3-4,9-10,17H2,1-2H3,(H,18,19)