(Z)-3-[[5-(2-butoxytetradecoxycarbonyl)-2-chloranyl-phenyl]amino]-3-ethoxy-prop-2-enoic acid

Systemtic Name: (Z)-3-[[5-(2-butoxytetradecoxycarbonyl)-2-chloranyl-phenyl]amino]-3-ethoxy-prop-2-enoic acid Openeye Name: (Z)-3-[5-(2-butoxytetradecoxycarbonyl)-2-chloro-anilino]-3-ethoxy-prop-2-enoic acid CAS Name: (Z)-3-[5-[2-butoxytetradecoxy(oxo)methyl]-2-chloroanilino]-3-ethoxy-2-propenoic acid IUPAC Name: (Z)-3-[5-(2-butoxytetradecoxycarbonyl)-2-chloroanilino]-3-ethoxyprop-2-enoic acid Traditional Name: (Z)-3-[5-(2-butoxytetradecoxycarbonyl)-2-chloro-anilino]-3-ethoxy-acrylic acid Formula: C30H48ClNO6 MolecularWeight: 554.15822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(COC(=O)C1=CC(=C(C=C1)Cl)NC(=CC(=O)O)OCC)OCCCC

Isomeric SMILES

CCCCCCCCCCCCC(COC(=O)C1=CC(=C(C=C1)Cl)N/C(=C/C(=O)O)/OCC)OCCCC

InChI

InChI=1S/C30H48ClNO6/c1-4-7-9-10-11-12-13-14-15-16-17-25(37-20-8-5-2)23-38-30(35)24-18-19-26(31)27(21-24)32-28(36-6-3)22-29(33)34/h18-19,21-22,25,32H,4-17,20,23H2,1-3H3,(H,33,34)/b28-22-