(E)-3-(7-methyl-1H-indazol-5-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoic acid

Systemtic Name: (E)-3-(7-methyl-1H-indazol-5-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoic acid Openeye Name: (E)-2-(benzyloxycarbonylamino)-3-(7-methyl-1H-indazol-5-yl)prop-2-enoic acid CAS Name: (E)-3-(7-methyl-1H-indazol-5-yl)-2-(phenylmethoxycarbonylamino)-2-propenoic acid IUPAC Name: (E)-3-(7-methyl-1H-indazol-5-yl)-2-(phenylmethoxycarbonylamino)prop-2-enoic acid Traditional Name: (E)-2-(benzyloxycarbonylamino)-3-(7-methyl-1H-indazol-5-yl)acrylic acid Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C=C(C(=O)O)NC(=O)OCC3=CC=CC=C3)C=NN2

Isomeric SMILES

CC1=C2C(=CC(=C1)/C=C(\C(=O)O)/NC(=O)OCC3=CC=CC=C3)C=NN2

InChI

InChI=1S/C19H17N3O4/c1-12-7-14(8-15-10-20-22-17(12)15)9-16(18(23)24)21-19(25)26-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,22)(H,21,25)(H,23,24)/b16-9+