tert-butyl N-[4-(2-chloroethyl)-3-[[(E)-3-(6-methoxypyridin-3-yl)prop-2-enoyl]amino]naphthalen-1-yl]carbamate

Systemtic Name: tert-butyl N-[4-(2-chloroethyl)-3-[[(E)-3-(6-methoxypyridin-3-yl)prop-2-enoyl]amino]naphthalen-1-yl]carbamate Openeye Name: tert-butyl N-[4-(2-chloroethyl)-3-[[(E)-3-(6-methoxy-3-pyridyl)prop-2-enoyl]amino]-1-naphthyl]carbamate CAS Name: N-[4-(2-chloroethyl)-3-[[(E)-3-(6-methoxy-3-pyridinyl)-1-oxoprop-2-enyl]amino]-1-naphthalenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(2-chloroethyl)-3-[[(E)-3-(6-methoxypyridin-3-yl)prop-2-enoyl]amino]naphthalen-1-yl]carbamate Traditional Name: N-[4-(2-chloroethyl)-3-[[(E)-3-(6-methoxy-3-pyridyl)acryloyl]amino]-1-naphthyl]carbamic acid tert-butyl ester Formula: C26H28ClN3O4 MolecularWeight: 481.97122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=C(C2=CC=CC=C21)CCCl)NC(=O)C=CC3=CN=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=C(C2=CC=CC=C21)CCCl)NC(=O)/C=C/C3=CN=C(C=C3)OC

InChI

InChI=1S/C26H28ClN3O4/c1-26(2,3)34-25(32)30-22-15-21(20(13-14-27)18-7-5-6-8-19(18)22)29-23(31)11-9-17-10-12-24(33-4)28-16-17/h5-12,15-16H,13-14H2,1-4H3,(H,29,31)(H,30,32)/b11-9+