naphthalen-1-ylmethyl 3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: naphthalen-1-ylmethyl 3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: 1-naphthylmethyl 3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoate CAS Name: 3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoate Traditional Name: 3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)acrylic acid 1-naphthylmethyl ester Formula: C25H21ClN2O2 MolecularWeight: 416.89944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCC2=CC=CC3=CC=CC=C32)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)OCC2=CC=CC3=CC=CC=C32)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2O2/c1-18-22(25(26)28(27-18)16-19-8-3-2-4-9-19)14-15-24(29)30-17-21-12-7-11-20-10-5-6-13-23(20)21/h2-15H,16-17H2,1H3