(E)-4-azanyl-3-[[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]methyl]pent-3-en-2-one

Systemtic Name: (E)-4-azanyl-3-[[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]methyl]pent-3-en-2-one Openeye Name: (E)-4-amino-3-[[4-(1,2-benzoxazol-3-yl)-1-piperidyl]methyl]pent-3-en-2-one CAS Name: (E)-4-amino-3-[[4-(1,2-benzoxazol-3-yl)-1-piperidinyl]methyl]-3-penten-2-one IUPAC Name: (E)-4-amino-3-[[4-(1,2-benzoxazol-3-yl)piperidin-1-yl]methyl]pent-3-en-2-one Traditional Name: (E)-4-amino-3-[(4-indoxazen-3-ylpiperidino)methyl]pent-3-en-2-one Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CN1CCC(CC1)C2=NOC3=CC=CC=C32)C(=O)C)N

Isomeric SMILES

C/C(=C(/CN1CCC(CC1)C2=NOC3=CC=CC=C32)\C(=O)C)/N

InChI

InChI=1S/C18H23N3O2/c1-12(19)16(13(2)22)11-21-9-7-14(8-10-21)18-15-5-3-4-6-17(15)23-20-18/h3-6,14H,7-11,19H2,1-2H3/b16-12+